| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 13th, 2006 | 12 | Yes |
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 0.86 | 5.74 | -37.91 | 1 | 2 | 1 | 17 | 163.244 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.86 | 6.01 | -92.85 | 2 | 2 | 2 | 19 | 164.252 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0671388A1; EP0671388B1 | IBM Patent Data |
